In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2010 | 15 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.61 | 6.18 | -7.11 | 1 | 3 | 0 | 32 | 206.289 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.61 | 6.55 | -39.91 | 2 | 3 | 1 | 34 | 207.297 | 4 | ↓ |